5-Aminoquinoxalin-2(1H)-one
Names and Identifiers of 5-Aminoquinoxalin-2(1H)-one
CAS Number |
1002129-56-7 |
|---|---|
MDL Number |
MFCD22571050 |
IUPAC Name |
5-amino-1H-quinoxalin-2-one |
InChI |
InChI=1S/C8H7N3O/c9-5-2-1-3-6-8(5)10-4-7(12)11-6/h1-4H,9H2,(H,11,12) |
InChIKey |
UNKJKGPIDUUPDM-UHFFFAOYSA-N |
Canonical SMILES |
C1=CC(=C2C(=C1)NC(=O)C=N2)N |
UNSPSC Code |
12352100 |
Physical and chemical properties of 5-Aminoquinoxalin-2(1H)-one
Exact Mass |
161.05900 |
|---|---|
LogP |
1.08650 |
Molecular Formula |
C8H7N3O |
Molecular Weight |
161.16100 |
PSA |
71.77000 |
Storage condition |
Keep in dark place,Inert atmosphere,Room temperature |
Safety Information of 5-Aminoquinoxalin-2(1H)-one
Applications of 5-Aminoquinoxalin-2(1H)-one
5-Aminoquinoxalin-2(1H)-one finds applications in various fields:
- Pharmaceuticals: Due to its biological activity, it serves as a lead compound for developing new drugs targeting specific diseases.
- Chemical Research: It acts as a building block in synthetic organic chemistry for creating more complex molecules.
- Fluorescent Probes: Its derivatives are explored for use in fluorescence-based applications due to their photophysical properties.
Interaction Studies of 5-Aminoquinoxalin-2(1H)-one
Interaction studies of 5-Aminoquinoxalin-2(1H)-one focus on its binding affinity and inhibitory effects on specific enzymes. Research indicates that it can interact with cytochrome P450 enzymes and potentially other targets involved in metabolic pathways. These interactions are critical for understanding its pharmacological profile and optimizing its therapeutic potential.
Biological Activity of 5-Aminoquinoxalin-2(1H)-one
5-Aminoquinoxalin-2(1H)-one exhibits significant biological activities, particularly as an inhibitor of various enzymes. Notably, it has been identified as a selective inhibitor of cytochrome P450 enzymes, specifically CYP1A2, which is involved in drug metabolism. This inhibition can affect the pharmacokinetics of co-administered drugs. Additionally, derivatives of this compound have shown promise in anti-cancer and anti-inflammatory activities.
Physical sample testing spectrum (NMR) of 5-Aminoquinoxalin-2(1H)-one
